362
 OpenBabel09292113343D

 41 42  0  0  1  0  0  0  0  0999 V2000
    8.6745    3.2085    1.5495 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.7570    3.1904    0.1219 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4233    2.0179   -0.4736 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1865    0.9614    0.0984 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.3009    2.2375   -1.9672 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8744    2.5831   -2.2416 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3908    3.8334   -2.1907 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0423    4.1252   -2.3227 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5920    5.5295   -2.2083 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.5671    6.2852   -1.4526 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.9223    6.9175   -0.3182 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1071    6.0897    0.9651 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4461    6.1413    1.4515 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0734    7.7478    1.5886 P   0  0  0  0  0  0  0  0  0  0  0  0
    5.9743    7.9721    2.6509 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.4098    7.0549    1.9188 O   0  5  0  0  0  0  0  0  0  0  0  0
    7.7007    9.3542    1.7257 O   0  5  0  0  0  0  0  0  0  0  0  0
    3.4701    7.0450   -0.7422 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.2867    8.1290   -1.6928 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2295    5.7599   -1.5154 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.1484    5.9671   -2.4378 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1337    3.1293   -2.6538 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9499    3.2950   -2.9248 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6291    1.8561   -2.6974 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.9303    1.4852   -2.5261 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2917    0.3197   -2.6508 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.9456    4.2074    1.8975 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.3791    2.4857    1.9721 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6541    2.9838    1.8760 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6306    1.3318   -2.4868 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9887    3.0314   -2.2813 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0650    4.6659   -1.9892 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5848    5.9413   -3.2256 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3727    7.9074   -0.2202 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8781    5.0341    0.7911 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4278    6.4375    1.7522 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7610    7.2023    0.0751 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0754    8.7029   -1.6167 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9763    4.9354   -0.8410 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1889    6.9267   -2.6397 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9682    1.1236   -2.9018 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 27  1  0  0  0  0
  1 28  1  0  0  0  0
  1 29  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 30  1  0  0  0  0
  5 31  1  0  0  0  0
  6  7  2  0  0  0  0
  6 25  1  0  0  0  0
  7  8  1  0  0  0  0
  7 32  1  0  0  0  0
  8  9  1  0  0  0  0
  8 22  1  0  0  0  0
  9 10  1  0  0  0  0
  9 20  1  0  0  0  0
  9 33  1  6  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 18  1  0  0  0  0
 11 34  1  1  0  0  0
 12 13  1  0  0  0  0
 12 35  1  0  0  0  0
 12 36  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 14 16  1  0  0  0  0
 14 17  1  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 18 37  1  1  0  0  0
 19 38  1  0  0  0  0
 20 21  1  0  0  0  0
 20 39  1  1  0  0  0
 21 40  1  0  0  0  0
 22 23  2  0  0  0  0
 22 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 41  1  0  0  0  0
 25 26  2  0  0  0  0
M  CHG  2  16  -1  17  -1
M  END
>  <Source>
MODOMICS database http://genesilico.pl/modomics/

$$$$
